Information card for entry 2230320

Structure parameters

• Chemical name: 2-[1-(3-Aminophenylimino)ethyl]phenol
• Formula: C14 H14 N2 O
• Calculated formula: C14 H14 N2 O
• SMILES: Oc1c(cccc1)C(=N\c1cc(N)ccc1)\C
• Title of publication: 2-[1-(3-Aminophenylimino)ethyl]phenol
• Authors of publication: Blagus, Anita; Kaitner, Branko
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 6
• Pages of publication: o1423
• a: 9.0625 ± 0.0002 Å
• b: 5.5777 ± 0.0002 Å
• c: 23.2349 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1174.48 ± 0.06 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0364
• Residual factor for significantly intense reflections: 0.0304
• Weighted residual factors for significantly intense reflections: 0.079
• Weighted residual factors for all reflections included in the refinement: 0.0867
• Goodness-of-fit parameter for all reflections included in the refinement: 1.101
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes